6-Chloro-9-(1-Phenylethyl)-9H-Purine
[CAS# 112089-30-2]

Identification

• Name: 6-Chloro-9-(1-Phenylethyl)-9H-Purine
• Synonyms: 6-Chloro-9-(1-phenyl-ethyl)-9H-purine; NSC108152
• Molecular Formula: C₁₃H₁₁ClN₄
• Molecular Weight: 258.71
• CAS Registry Number: 112089-30-2
• SMILES: Clc3ncnc1c3ncn1C(c2ccccc2)C
• InChI: 1S/C13H11ClN4/c1-9(10-5-3-2-4-6-10)18-8-17-11-12(14)15-7-16-13(11)18/h2-9H,1H3
• InChIKey: XTFDZVGPYVRMGL-UHFFFAOYSA-N

Properties

• Density: 1.363g/cm³ (Cal.)
• Boiling point: 433.999°C at 760 mmHg (Cal.)
• Flash point: 216.275°C (Cal.)
• Refractive index: 1.687 (Cal.)